Information card for entry 2205760

Structure parameters

• Common name: Dibenz[a,c]anthracene
• Chemical name: 1,2:5,6-Dibenzanthracene
• Formula: C22 H14
• Calculated formula: C22 H14
• SMILES: c1cc2c(cc1)cc1c(c2)c2c(cccc2)c2c1cccc2
• Title of publication: Powder diffraction study of 1,2:3,4-dibenzanthracene
• Authors of publication: Fernandes, Philippe; Florence, Alastair; Shankland, Kenneth; David, Bill
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 5
• Pages of publication: o1483 - o1485
• a: 18.2966 ± 0.0005 Å
• b: 5.06225 ± 0.0001 Å
• c: 15.7245 ± 0.0004 Å
• α: 90°
• β: 104.557 ± 0.0015°
• γ: 90°
• Cell volume: 1409.68 ± 0.06 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 2
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Goodness-of-fit parameter for all reflections: 1.64
• Diffraction radiation wavelength: 1.54056 Å
• Diffraction radiation type: CuKα1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No